[2-methoxy-5-[[2-methoxyethyl-[(4-methylphenyl)carbamoyl]amino]methyl]phenyl] 3-(trifluoromethyl)benzenesulfonate

Systemtic Name: [2-methoxy-5-[[2-methoxyethyl-[(4-methylphenyl)carbamoyl]amino]methyl]phenyl] 3-(trifluoromethyl)benzenesulfonate Openeye Name: [2-methoxy-5-[[2-methoxyethyl(p-tolylcarbamoyl)amino]methyl]phenyl] 3-(trifluoromethyl)benzenesulfonate CAS Name: 3-(trifluoromethyl)benzenesulfonic acid [2-methoxy-5-[[2-methoxyethyl-[(4-methylanilino)-oxomethyl]amino]methyl]phenyl] ester IUPAC Name: [2-methoxy-5-[[2-methoxyethyl-[(4-methylphenyl)carbamoyl]amino]methyl]phenyl] 3-(trifluoromethyl)benzenesulfonate Traditional Name: 3-(trifluoromethyl)benzenesulfonic acid [2-methoxy-5-[[2-methoxyethyl(p-tolylcarbamoyl)amino]methyl]phenyl] ester Formula: C26H27F3N2O6S MolecularWeight: 552.56259

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N(CCOC)CC2=CC(=C(C=C2)OC)OS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N(CCOC)CC2=CC(=C(C=C2)OC)OS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C26H27F3N2O6S/c1-18-7-10-21(11-8-18)30-25(32)31(13-14-35-2)17-19-9-12-23(36-3)24(15-19)37-38(33,34)22-6-4-5-20(16-22)26(27,28)29/h4-12,15-16H,13-14,17H2,1-3H3,(H,30,32)